HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_full&page=30",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_full&page=28",
"results": [
{
"id": "jvasp-36666",
"created_at": "2022-09-04T14:37:32.554867Z",
"updated_at": "2022-09-04T14:37:32.554893Z",
"structure_string": "Zr2 Rh2\n1.0\n0.000000 3.290753 -0.002065\n4.658328 0.000000 0.000000\n0.000000 -0.002948 -4.658525\nZr Rh\n2 2\ndirect\n0.499998 0.250000 0.250007 Zr\n0.500000 0.750000 0.749991 Zr\n-0.000065 0.750000 0.250029 Rh\n0.000065 0.250000 0.749970 Rh\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zr",
"Rh"
],
"chemical_system": "Rh-Zr",
"density": 9.028106543135312,
"density_atomic": 0.056012639416293204,
"volume": 71.41245336202569,
"volume_molar": 10.75139615407635,
"formula_full": "Zr2 Rh2",
"formula_reduced": "ZrRh",
"formula_anonymous": "AB",
"energy_above_hull": 2.00350375,
"spacegroup": 221
},
{
"id": "jvasp-79585",
"created_at": "2022-09-04T14:37:13.047020Z",
"updated_at": "2022-09-04T14:37:13.047059Z",
"structure_string": "Zr2 Pt2\n1.0\n-3.470388 0.000000 0.000000\n-0.000000 -0.000000 -4.291826\n1.735193 -5.204848 -0.000000\nZr Pt\n2 2\ndirect\n0.858632 0.750001 0.717261 Zr\n0.141370 0.250000 0.282739 Zr\n0.593091 0.750001 0.186181 Pt\n0.406911 0.250000 0.813819 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zr",
"Pt"
],
"chemical_system": "Pt-Zr",
"density": 12.265475403332298,
"density_atomic": 0.051597873194399624,
"volume": 77.52257510555988,
"volume_molar": 11.671296484083836,
"formula_full": "Zr2 Pt2",
"formula_reduced": "ZrPt",
"formula_anonymous": "AB",
"energy_above_hull": 1.7315179500000006,
"spacegroup": 63
},
{
"id": "jvasp-79768",
"created_at": "2022-09-04T14:37:14.597327Z",
"updated_at": "2022-09-04T14:37:14.597351Z",
"structure_string": "Zr2 Pd2\n1.0\n-3.398228 -0.000000 -0.000000\n0.000000 -0.000000 -4.351229\n1.699114 -5.196806 -0.000000\nZr Pd\n2 2\ndirect\n0.858453 0.750000 0.716904 Zr\n0.141550 0.250000 0.283097 Zr\n0.589345 0.750000 0.178689 Pd\n0.410658 0.250000 0.821312 Pd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zr",
"Pd"
],
"chemical_system": "Pd-Zr",
"density": 8.542043307826013,
"density_atomic": 0.05205459026888882,
"volume": 76.84240677600066,
"volume_molar": 11.568894748556342,
"formula_full": "Zr2 Pd2",
"formula_reduced": "ZrPd",
"formula_anonymous": "AB",
"energy_above_hull": 1.6481051000000004,
"spacegroup": 63
},
{
"id": "jvasp-14631",
"created_at": "2022-09-04T14:35:49.818411Z",
"updated_at": "2022-09-04T14:35:49.818447Z",
"structure_string": "Zr2 Pd1\n1.0\n3.207078 0.000000 -0.931312\n-0.270446 3.195655 -0.931312\n-0.022556 -0.024546 5.909950\nZr Pd\n2 1\ndirect\n0.656475 0.656474 0.312953 Zr\n0.343523 0.343523 0.687047 Zr\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Zr",
"Pd"
],
"chemical_system": "Pd-Zr",
"density": 7.938673288491605,
"density_atomic": 0.04965015994239919,
"volume": 60.42276607931173,
"volume_molar": 12.12914674793895,
"formula_full": "Zr2 Pd1",
"formula_reduced": "Zr2Pd",
"formula_anonymous": "AB2",
"energy_above_hull": 2.8744382333333336,
"spacegroup": 139
},
{
"id": "jvasp-29255",
"created_at": "2022-09-04T14:37:38.893993Z",
"updated_at": "2022-09-04T14:37:38.894018Z",
"structure_string": "Zr2 Pb6 F20\n1.0\n6.040511 0.000000 0.000000\n-0.000000 8.180523 -1.519507\n0.000000 -0.044039 8.320332\nZr Pb F\n2 6 20\ndirect\n0.750000 0.818204 0.181796 Zr\n0.250000 0.181796 0.818204 Zr\n0.750000 0.388698 0.611302 Pb\n0.750000 0.321724 0.108721 Pb\n0.250000 0.678275 0.891278 Pb\n0.250000 0.108721 0.321724 Pb\n0.750000 0.891278 0.678275 Pb\n0.250000 0.611302 0.388698 Pb\n0.461904 0.152911 0.604575 F\n0.961904 0.847088 0.395425 F\n0.538096 0.604575 0.152911 F\n0.038096 0.395425 0.847088 F\n0.538096 0.847088 0.395425 F\n0.038096 0.152911 0.604575 F\n0.750000 0.077424 0.258149 F\n0.500000 0.363720 0.363720 F\n0.000000 0.636279 0.636279 F\n0.500000 0.636279 0.636279 F\n0.000000 0.363720 0.363720 F\n0.954283 0.100974 0.899026 F\n0.454283 0.899025 0.100974 F\n0.045717 0.899025 0.100974 F\n0.545717 0.100974 0.899026 F\n0.750000 0.741851 0.922576 F\n0.250000 0.258149 0.077424 F\n0.250000 0.922576 0.741851 F\n0.961904 0.604575 0.152911 F\n0.461904 0.395425 0.847088 F\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Zr",
"Pb",
"F"
],
"chemical_system": "F-Pb-Zr",
"density": 7.299721432049142,
"density_atomic": 0.06816945330731447,
"volume": 410.74115518828205,
"volume_molar": 8.834075187388711,
"formula_full": "Zr2 Pb6 F20",
"formula_reduced": "ZrPb3F10",
"formula_anonymous": "AB3C10",
"energy_above_hull": 0.0989456989285711,
"spacegroup": 63
},
{
"id": "jvasp-100450",
"created_at": "2022-09-04T14:36:41.309266Z",
"updated_at": "2022-09-04T14:36:41.309282Z",
"structure_string": "Zr2 Pb2 N4\n1.0\n4.058386 -0.000000 0.000000\n0.000000 4.058386 -0.000000\n0.000000 0.000000 8.097622\nZr Pb N\n2 2 4\ndirect\n0.750001 0.750001 0.599144 Zr\n0.250000 0.250000 0.400855 Zr\n0.750001 0.750001 0.136495 Pb\n0.250000 0.250000 0.863505 Pb\n0.750001 0.250000 0.500000 N\n0.250000 0.750001 0.500000 N\n0.750001 0.750001 0.853558 N\n0.250000 0.250000 0.146442 N\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Zr",
"Pb",
"N"
],
"chemical_system": "N-Pb-Zr",
"density": 8.128582185307609,
"density_atomic": 0.05998266879477342,
"volume": 133.37185825077992,
"volume_molar": 10.039801297612053,
"formula_full": "Zr2 Pb2 N4",
"formula_reduced": "ZrPbN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.507560455,
"spacegroup": 129
},
{
"id": "jvasp-21474",
"created_at": "2022-09-04T14:37:52.038134Z",
"updated_at": "2022-09-04T14:37:52.038171Z",
"structure_string": "Zr2 Pb2 F12\n1.0\n5.348324 0.000000 -0.000000\n0.000000 6.314205 -2.519373\n-0.000000 -0.009522 6.798260\nZr Pb F\n2 2 12\ndirect\n0.000000 0.750000 0.750000 Zr\n0.000000 0.250000 0.250000 Zr\n0.463159 0.750000 0.250000 Pb\n0.536840 0.250000 0.750000 Pb\n0.743089 0.440849 0.184228 F\n0.743089 0.059151 0.315772 F\n0.256910 0.184228 0.440849 F\n0.256910 0.315771 0.059151 F\n0.838074 0.429468 0.570532 F\n0.838074 0.070532 0.929468 F\n0.161925 0.570532 0.429468 F\n0.161925 0.929467 0.070532 F\n0.743089 0.684228 0.940850 F\n0.743089 0.815771 0.559151 F\n0.256910 0.940849 0.684229 F\n0.256910 0.559151 0.815772 F\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Zr",
"Pb",
"F"
],
"chemical_system": "F-Pb-Zr",
"density": 5.969274570105444,
"density_atomic": 0.06973143524596973,
"volume": 229.45175219127233,
"volume_molar": 8.636192183278004,
"formula_full": "Zr2 Pb2 F12",
"formula_reduced": "ZrPbF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.108234626875,
"spacegroup": 67
},
{
"id": "jvasp-10219",
"created_at": "2022-09-04T14:38:12.383079Z",
"updated_at": "2022-09-04T14:38:12.383105Z",
"structure_string": "Zr2 P4 S12\n1.0\n6.724926 -0.000000 0.000000\n0.000000 6.724926 0.000000\n0.000000 0.000000 9.558102\nZr P S\n2 4 12\ndirect\n0.000000 0.000000 0.750000 Zr\n0.000000 0.000000 0.250000 Zr\n0.657268 0.059192 0.000000 P\n0.342733 0.940808 0.000000 P\n0.059192 0.342733 0.500000 P\n0.940808 0.657268 0.500000 P\n0.784929 0.692380 0.320565 S\n0.307620 0.784929 0.820565 S\n0.692380 0.215071 0.820565 S\n0.215071 0.307620 0.320565 S\n0.841356 0.816324 0.000000 S\n0.158644 0.183676 0.000000 S\n0.816324 0.158644 0.500000 S\n0.784929 0.692380 0.679435 S\n0.692380 0.215071 0.179435 S\n0.215071 0.307620 0.679435 S\n0.183676 0.841356 0.500000 S\n0.307620 0.784929 0.179435 S\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Zr",
"P",
"S"
],
"chemical_system": "P-S-Zr",
"density": 2.654958845004864,
"density_atomic": 0.04164144817794139,
"volume": 432.2616236371695,
"volume_molar": 14.461890792717655,
"formula_full": "Zr2 P4 S12",
"formula_reduced": "Zr(PS3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 2.764638388888889,
"spacegroup": 84
},
{
"id": "jvasp-34727",
"created_at": "2022-09-04T14:37:56.377165Z",
"updated_at": "2022-09-04T14:37:56.377191Z",
"structure_string": "Zr2 P4 O14\n1.0\n5.470288 0.000000 0.000000\n0.000000 6.824755 -0.000000\n0.000000 -0.000000 8.526942\nZr P O\n2 4 14\ndirect\n0.000000 0.500000 0.000000 Zr\n0.500000 0.000000 0.500000 Zr\n0.000000 0.310985 0.392941 P\n0.500000 0.810985 0.107059 P\n0.500000 0.189015 0.892941 P\n0.000000 0.689014 0.607059 P\n0.768986 0.197854 0.432804 O\n0.000000 0.500000 0.500000 O\n0.268986 0.302146 0.932804 O\n0.768986 0.802145 0.567195 O\n0.500000 0.118912 0.723961 O\n0.231014 0.802145 0.567195 O\n0.231014 0.197854 0.432804 O\n0.000000 0.618912 0.776039 O\n0.731015 0.697854 0.067196 O\n0.000000 0.381087 0.223961 O\n0.500000 0.881087 0.276039 O\n0.268986 0.697854 0.067196 O\n0.731015 0.302146 0.932804 O\n0.500000 0.000000 0.000000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Zr",
"P",
"O"
],
"chemical_system": "O-P-Zr",
"density": 2.766358959534341,
"density_atomic": 0.062826002847772,
"volume": 318.3395265247129,
"volume_molar": 9.585427191017875,
"formula_full": "Zr2 P4 O14",
"formula_reduced": "ZrP2O7",
"formula_anonymous": "AB2C7",
"energy_above_hull": 2.978808,
"spacegroup": 58
},
{
"id": "jvasp-110117",
"created_at": "2022-09-04T14:38:16.594688Z",
"updated_at": "2022-09-04T14:38:16.594709Z",
"structure_string": "Zr2 P3 S1\n1.0\n3.623634 0.000000 0.000000\n0.000000 3.623634 0.000000\n0.000000 0.000000 7.855687\nZr P S\n2 3 1\ndirect\n0.499999 0.499999 0.266659 Zr\n0.000000 0.000000 0.734184 Zr\n0.499999 0.000000 0.998450 P\n-0.000000 0.499999 0.998450 P\n0.000000 0.000000 0.379004 P\n0.499999 0.499999 0.623254 S\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Zr",
"P",
"S"
],
"chemical_system": "P-S-Zr",
"density": 4.9491267229247855,
"density_atomic": 0.058167235989086116,
"volume": 103.15085284653678,
"volume_molar": 10.35314925593152,
"formula_full": "Zr2 P3 S1",
"formula_reduced": "Zr2P3S",
"formula_anonymous": "AB2C3",
"energy_above_hull": 3.397505916666667,
"spacegroup": 99
},
{
"id": "jvasp-38858",
"created_at": "2022-09-04T14:38:06.795944Z",
"updated_at": "2022-09-04T14:38:06.795972Z",
"structure_string": "Zr2 Os1 Ru1\n1.0\n0.000008 3.279320 3.279321\n3.279329 0.000006 3.279323\n3.279335 3.279328 -0.000000\nZr Os Ru\n2 1 1\ndirect\n0.000001 0.000000 0.000000 Zr\n0.500000 0.499999 0.500001 Zr\n0.250000 0.250000 0.250000 Os\n0.750000 0.749999 0.750001 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Os",
"Ru"
],
"chemical_system": "Os-Ru-Zr",
"density": 11.15356342935256,
"density_atomic": 0.05671228498726021,
"volume": 70.53145541391174,
"volume_molar": 10.618758812756017,
"formula_full": "Zr2 Os1 Ru1",
"formula_reduced": "Zr2OsRu",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.598566125,
"spacegroup": 225
},
{
"id": "jvasp-81701",
"created_at": "2022-09-04T14:37:08.935655Z",
"updated_at": "2022-09-04T14:37:08.935674Z",
"structure_string": "Zr2 Os1 Pd1\n1.0\n-8.934114 0.000000 -5.158113\n-5.796251 -1.242238 -0.276824\n-4.324525 2.920433 -2.825929\nZr Os Pd\n2 1 1\ndirect\n0.745788 0.000000 -0.000000 Zr\n0.254212 0.000000 -0.000000 Zr\n0.500000 0.000000 -0.000000 Os\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Os",
"Pd"
],
"chemical_system": "Os-Pd-Zr",
"density": 10.407872884863757,
"density_atomic": 0.05232973257788335,
"volume": 76.43838030409812,
"volume_molar": 11.508067141442263,
"formula_full": "Zr2 Os1 Pd1",
"formula_reduced": "Zr2OsPd",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.139049925,
"spacegroup": 71
}
]
}